sodium (2E,4S)-2-(3-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-methyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: sodium (2E,4S)-2-(3-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-methyl-1,3-thiazolidine-4-carboxylate Openeye Name: sodium (2E,4S)-2-(3-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-4-methyl-thiazolidine-4-carboxylate CAS Name: sodium (2E,4S)-2-(3-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-4-methyl-4-thiazolidinecarboxylate IUPAC Name: sodium (2E,4S)-2-(3-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-4-methyl-1,3-thiazolidine-4-carboxylate Traditional Name: sodium (2E,4S)-2-(6-keto-3-methoxy-cyclohexa-2,4-dien-1-ylidene)-4-methyl-thiazolidine-4-carboxylate Formula: C12H12NNaO4S MolecularWeight: 289.28275

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC(=C2C=C(C=CC2=O)OC)N1)C(=O)[O-].[Na+]

Isomeric SMILES

C[C@@]1(CS/C(=C/2\C=C(C=CC2=O)OC)/N1)C(=O)[O-].[Na+]

InChI

InChI=1S/C12H13NO4S.Na/c1-12(11(15)16)6-18-10(13-12)8-5-7(17-2)3-4-9(8)14;/h3-5,13H,6H2,1-2H3,(H,15,16);/q;+1/p-1/b10-8+;/t12-;/m1./s1